methyl 1-cyclohexyl-4,6-bis(oxidanylidene)-10b-phenyl-3aH-[2]benzoxepino[5,4-b]pyrrole-3-carboxylate

Systemtic Name: methyl 1-cyclohexyl-4,6-bis(oxidanylidene)-10b-phenyl-3aH-[2]benzoxepino[5,4-b]pyrrole-3-carboxylate Openeye Name: methyl 1-cyclohexyl-4,6-dioxo-10b-phenyl-3aH-[2]benzoxepino[5,4-b]pyrrole-3-carboxylate CAS Name: 1-cyclohexyl-4,6-dioxo-10b-phenyl-3aH-[2]benzoxepino[5,4-b]pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-cyclohexyl-4,6-dioxo-10b-phenyl-3aH-[2]benzoxepino[5,4-b]pyrrole-3-carboxylate Traditional Name: 1-cyclohexyl-4,6-diketo-10b-phenyl-3aH-[2]benzoxepino[5,4-b]pyrrole-3-carboxylic acid methyl ester Formula: C26H25NO5 MolecularWeight: 431.4804

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2(C1C(=O)OC(=O)C3=CC=CC=C32)C4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

COC(=O)C1=CN(C2(C1C(=O)OC(=O)C3=CC=CC=C32)C4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C26H25NO5/c1-31-23(28)20-16-27(18-12-6-3-7-13-18)26(17-10-4-2-5-11-17)21-15-9-8-14-19(21)24(29)32-25(30)22(20)26/h2,4-5,8-11,14-16,18,22H,3,6-7,12-13H2,1H3